Revisiting the calculation of (13)C chemical shift tensors in cadmium acetate dihydrate with EIM and EIM/cluster methods
The chemical shift tensors of the acetate anions in cadmium acetate dihydrate are calculated using a cluster approach, the embedded ion method (EIM), and a combination of the two in the EIM/cluster method. The results of these calculations are compared with those completed on the isolated acetate an...
| Veröffentlicht in: | Magnetic resonance in chemistry : MRC. - 1985. - 44(2006), 3 vom: 13. März, Seite 385-9 |
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| Format: | Aufsatz |
| Sprache: | English |
| Veröffentlicht: |
2006
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| Zugriff auf das übergeordnete Werk: | Magnetic resonance in chemistry : MRC |
| Schlagworte: | Journal Article Research Support, N.I.H., Extramural Acetates Carbon Isotopes Cadmium 00BH33GNGH cadmium acetate 95KC50Z1L0 |